Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rti_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 11.A N TRP 49.A O no hydrogen 2.652 N/A ARG 12.A N THR 134.A O no hydrogen 3.261 N/A ARG 12.A NH2 ASN 42.A O no hydrogen 3.104 N/A VAL 14.A N LEU 132.A O no hydrogen 3.006 N/A GLY 15.A N LEU 19.A O no hydrogen 2.904 N/A ARG 16.A NH1 ALA 109.A O no hydrogen 2.607 N/A ARG 16.A NH2 GLY 205.A O no hydrogen 2.866 N/A ASN 17.A N ASP 175.A OD2 no hydrogen 2.759 N/A ASN 17.A ND2 GLY 112.A O no hydrogen 3.212 N/A GLY 18.A N GLY 15.A O no hydrogen 2.709 N/A LEU 19.A N ARG 16.A O no hydrogen 3.015 N/A CYS 20.A N TRP 37.A O no hydrogen 2.851 N/A VAL 21.A N ILE 13.A O no hydrogen 2.834 N/A ASP 22.A N GLN 35.A O no hydrogen 2.590 N/A VAL 23.A N ASN 46.A O no hydrogen 2.919 N/A ARG 24.A N ALA 33.A O no hydrogen 3.035 N/A ARG 24.A NE GLN 35.A OE1 no hydrogen 3.053 N/A ARG 24.A NH2 GLN 35.A OE1 no hydrogen 3.140 N/A ARG 24.A NH2 GLY 115.A O no hydrogen 2.886 N/A ARG 24.A NH2 THR 117.A OG1 no hydrogen 2.948 N/A GLY 26.A N VAL 23.A O no hydrogen 3.157 N/A ARG 27.A N ARG 24.A O no hydrogen 3.268 N/A GLY 31.A N ILE 77.A O no hydrogen 2.889 N/A ASN 32.A N HIS 29.A O no hydrogen 3.068 N/A ASN 32.A ND2 ARG 24.A O no hydrogen 2.676 N/A ASN 32.A ND2 ARG 27.A O no hydrogen 2.689 N/A ILE 34.A N VAL 75.A O no hydrogen 3.159 N/A GLN 35.A N ASP 22.A O no hydrogen 2.601 N/A GLN 35.A NE2 ASP 22.A OD1 no hydrogen 3.478 N/A LEU 36.A N THR 116.A O no hydrogen 2.923 N/A TRP 37.A N CYS 20.A O no hydrogen 2.972 N/A CYS 39.A SG GLY 18.A O no hydrogen 3.406 N/A LYS 40.A N GLN 47.A OE1 no hydrogen 2.581 N/A LYS 40.A NZ ASP 44.A OD2 no hydrogen 2.706 N/A LYS 40.A NZ ASN 46.A OD1 no hydrogen 2.864 N/A ASP 44.A N ASN 42.A OD1 no hydrogen 2.702 N/A ASN 46.A ND2 VAL 23.A O no hydrogen 2.945 N/A GLN 47.A N ASP 44.A O no hydrogen 3.105 N/A GLN 47.A NE2 ASP 22.A OD2 no hydrogen 2.898 N/A GLN 47.A NE2 PRO 38.A O no hydrogen 3.101 N/A LEU 48.A N ALA 45.A O no hydrogen 3.259 N/A TRP 49.A N VAL 11.A O no hydrogen 2.671 N/A TRP 49.A NE1 VAL 21.A O no hydrogen 3.076 N/A THR 50.A N ARG 58.A O no hydrogen 2.700 N/A LEU 51.A N PRO 9.A O no hydrogen 3.081 N/A LYS 52.A N THR 56.A O no hydrogen 3.040 N/A LYS 52.A NZ GLU 8.A OE1 no hydrogen 3.083 N/A ARG 53.A N GLU 8.A OE2 no hydrogen 3.035 N/A ASN 55.A N LYS 52.A O no hydrogen 3.271 N/A THR 56.A N ASP 54.A OD1 no hydrogen 3.059 N/A THR 56.A OG1 ASP 54.A OD1 no hydrogen 2.808 N/A THR 56.A OG1 ASP 54.A OD2 no hydrogen 3.417 N/A ARG 58.A N THR 50.A O no hydrogen 2.888 N/A ARG 58.A NE THR 56.A OG1 no hydrogen 2.842 N/A ARG 58.A NH2 THR 56.A OG1 no hydrogen 3.403 N/A SER 59.A N LYS 62.A O no hydrogen 3.149 N/A SER 59.A OG ALA 45.A O no hydrogen 2.759 N/A LYS 62.A N SER 59.A O no hydrogen 2.970 N/A LYS 62.A NZ PHE 28.A O no hydrogen 2.674 N/A LYS 62.A NZ ASN 30.A OD1 no hydrogen 2.913 N/A CYS 63.A N TYR 78.A O no hydrogen 2.782 N/A LEU 64.A N ILE 57.A O no hydrogen 2.964 N/A THR 65.A N MET 76.A O no hydrogen 2.791 N/A THR 65.A OG1 CYS 63.A O no hydrogen 2.788 N/A THR 66.A N ALA 87.A O no hydrogen 3.021 N/A THR 66.A OG1 GLY 68.A O no hydrogen 2.860 N/A TYR 67.A N TYR 74.A O no hydrogen 3.047 N/A TYR 69.A OH ASP 86.A O no hydrogen 3.301 N/A GLY 72.A N VAL 120.A O no hydrogen 2.998 N/A VAL 73.A N SER 70.A O no hydrogen 3.198 N/A TYR 74.A OH GLY 31.A O no hydrogen 2.965 N/A VAL 75.A N LEU 118.A O no hydrogen 2.790 N/A MET 76.A N THR 65.A O no hydrogen 2.718 N/A ILE 77.A N ASN 32.A O no hydrogen 2.861 N/A TYR 78.A N CYS 63.A O no hydrogen 3.007 N/A ASP 79.A N ASN 30.A OD1 no hydrogen 3.003 N/A CYS 80.A SG GLY 61.A O no hydrogen 3.789 N/A ASN 81.A N ASP 79.A OD1 no hydrogen 2.863 N/A THR 82.A OG1 ASP 79.A OD2 no hydrogen 2.875 N/A ALA 83.A N ASP 79.A O no hydrogen 3.051 N/A ALA 87.A N THR 85.A O no hydrogen 2.792 N/A THR 88.A N THR 85.A O no hydrogen 3.187 N/A THR 88.A OG1 THR 85.A O no hydrogen 2.674 N/A TRP 90.A N ASN 55.A O no hydrogen 2.941 N/A TRP 90.A NE1 LEU 64.A O no hydrogen 2.994 N/A GLN 91.A N ILE 99.A O no hydrogen 2.923 N/A TRP 93.A N THR 97.A O no hydrogen 2.761 N/A TRP 93.A NE1 GLN 91.A OE1 no hydrogen 3.226 N/A ILE 99.A N GLN 91.A O no hydrogen 3.016 N/A ASN 100.A N LEU 105.A O no hydrogen 2.994 N/A ASN 100.A ND2 SER 103.A OG no hydrogen 2.560 N/A ARG 102.A NE ASP 86.A OD1 no hydrogen 3.074 N/A SER 103.A N ASN 100.A O no hydrogen 3.382 N/A SER 104.A N ASN 100.A O no hydrogen 2.805 N/A LEU 105.A N SER 103.A OG no hydrogen 3.156 N/A VAL 106.A N GLN 121.A O no hydrogen 2.767 N/A LEU 107.A N ILE 98.A O no hydrogen 2.950 N/A ALA 108.A N THR 119.A O no hydrogen 2.711 N/A ALA 109.A N SER 128.A O no hydrogen 2.953 N/A SER 111.A OG THR 116.A OG1 no hydrogen 3.312 N/A ASN 113.A N SER 111.A OG no hydrogen 3.410 N/A GLY 115.A N LEU 36.A O no hydrogen 2.973 N/A THR 116.A N ASN 113.A O no hydrogen 3.269 N/A THR 116.A OG1 ASN 113.A O no hydrogen 2.982 N/A LEU 118.A N ILE 34.A O no hydrogen 2.814 N/A THR 119.A N ALA 108.A O no hydrogen 3.125 N/A VAL 120.A N VAL 73.A O no hydrogen 3.156 N/A GLN 121.A N VAL 106.A O no hydrogen 2.891 N/A GLN 121.A NE2 THR 119.A OG1 no hydrogen 2.626 N/A ILE 124.A N GLN 129.A OE1 no hydrogen 2.914 N/A TYR 125.A N ASN 123.A OD1 no hydrogen 3.022 N/A ALA 126.A N GLN 129.A OE1 no hydrogen 3.401 N/A VAL 127.A N ALA 207.A O no hydrogen 2.982 N/A VAL 127.A N SER 208.A O no hydrogen 3.436 N/A GLN 129.A N ALA 126.A O no hydrogen 2.870 N/A GLN 129.A NE2 THR 122.A O no hydrogen 3.087 N/A GLY 130.A N VAL 127.A O no hydrogen 3.383 N/A TRP 131.A N GLY 96.A O no hydrogen 2.736 N/A TRP 131.A NE1 LEU 107.A O no hydrogen 2.851 N/A LEU 132.A N VAL 14.A O no hydrogen 2.881 N/A THR 134.A N ARG 12.A O no hydrogen 2.849 N/A ASN 136.A N THR 134.A OG1 no hydrogen 2.774 N/A PHE 140.A N LEU 172.A O no hydrogen 3.099 N/A THR 142.A N TRP 170.A O no hydrogen 2.716 N/A THR 143.A N LEU 258.A O no hydrogen 3.145 N/A VAL 145.A N LEU 256.A O no hydrogen 2.958 N/A GLY 146.A N LEU 150.A O no hydrogen 2.626 N/A GLY 149.A N GLY 146.A O no hydrogen 2.792 N/A LEU 150.A N LEU 147.A O no hydrogen 3.029 N/A CYS 151.A N GLU 162.A O no hydrogen 2.662 N/A CYS 151.A SG ILE 144.A O no hydrogen 4.035 N/A LEU 152.A N ILE 144.A O no hydrogen 2.917 N/A GLN 153.A N TRP 160.A O no hydrogen 2.684 N/A ASN 155.A N GLN 158.A O no hydrogen 3.052 N/A TRP 160.A N GLN 153.A O no hydrogen 2.928 N/A GLU 162.A N CYS 151.A O no hydrogen 2.885 N/A CYS 164.A SG GLY 149.A O no hydrogen 3.364 N/A SER 165.A N GLN 168.A OE1 no hydrogen 3.370 N/A SER 166.A OG SER 166.A O no hydrogen 2.558 N/A GLN 168.A NE2 GLN 153.A OE1 no hydrogen 2.461 N/A GLN 168.A NE2 ASP 163.A O no hydrogen 3.478 N/A TRP 170.A N THR 142.A O no hydrogen 2.688 N/A TRP 170.A NE1 LEU 152.A O no hydrogen 2.949 N/A ALA 171.A N ARG 179.A O no hydrogen 2.641 N/A LEU 172.A N PHE 140.A O no hydrogen 2.663 N/A TYR 173.A N SER 177.A O no hydrogen 3.053 N/A GLY 176.A N TYR 173.A O no hydrogen 2.973 N/A SER 177.A N ASP 175.A OD1 no hydrogen 3.003 N/A SER 177.A OG ASP 175.A OD1 no hydrogen 2.624 N/A ARG 179.A N ALA 171.A O no hydrogen 2.859 N/A ARG 179.A NE SER 177.A OG no hydrogen 2.916 N/A ARG 179.A NH1 ASN 17.A OD1 no hydrogen 3.510 N/A ARG 179.A NH1 ARG 184.A O no hydrogen 2.989 N/A ARG 179.A NH2 ASN 17.A OD1 no hydrogen 2.998 N/A ARG 179.A NH2 ASP 175.A OD2 no hydrogen 2.925 N/A GLN 181.A N GLN 169.A O no hydrogen 3.212 N/A ASN 183.A N PRO 180.A O no hydrogen 2.783 N/A ASN 186.A N ASN 183.A O no hydrogen 3.084 N/A CYS 187.A N LEU 202.A O no hydrogen 2.686 N/A LEU 188.A N ILE 178.A O no hydrogen 2.878 N/A THR 189.A N LYS 200.A O no hydrogen 2.638 N/A THR 189.A OG1 CYS 187.A O no hydrogen 2.869 N/A SER 190.A N GLY 210.A O no hydrogen 3.021 N/A SER 190.A OG SER 192.A O no hydrogen 2.998 N/A ARG 195.A NH2 TYR 245.A OH no hydrogen 2.549 N/A GLU 196.A N ILE 194.A O no hydrogen 2.478 N/A THR 197.A N ILE 194.A O no hydrogen 3.109 N/A THR 197.A OG1 ILE 194.A O no hydrogen 3.515 N/A VAL 199.A N ILE 242.A O no hydrogen 2.794 N/A LYS 200.A N THR 189.A O no hydrogen 2.680 N/A ILE 201.A N GLY 157.A O no hydrogen 3.032 N/A LEU 202.A N CYS 187.A O no hydrogen 3.267 N/A CYS 204.A N ASP 185.A O no hydrogen 3.271 N/A GLY 205.A N SER 203.A OG no hydrogen 2.951 N/A ALA 207.A N CYS 204.A O no hydrogen 2.827 N/A SER 208.A N GLN 211.A OE1 no hydrogen 2.819 N/A SER 208.A OG GLN 211.A OE1 no hydrogen 3.259 N/A GLN 211.A N SER 208.A O no hydrogen 3.102 N/A GLN 211.A NE2 THR 189.A OG1 no hydrogen 2.946 N/A GLN 211.A NE2 SER 203.A O no hydrogen 2.864 N/A ARG 212.A NH1 ALA 126.A O no hydrogen 2.951 N/A ARG 212.A NH2 ASN 95.A O no hydrogen 2.645 N/A ARG 212.A NH2 THR 97.A OG1 no hydrogen 3.219 N/A TRP 213.A N GLY 176.A O no hydrogen 2.942 N/A TRP 213.A NE1 LEU 188.A O no hydrogen 2.896 N/A MET 214.A N LEU 222.A O no hydrogen 2.813 N/A LYS 216.A N THR 220.A O no hydrogen 2.818 N/A GLY 219.A N LYS 216.A O no hydrogen 3.390 N/A THR 220.A N ASP 218.A OD1 no hydrogen 3.187 N/A THR 220.A OG1 ASP 218.A OD1 no hydrogen 2.690 N/A LEU 222.A N MET 214.A O no hydrogen 2.778 N/A ASN 223.A N LEU 228.A O no hydrogen 2.821 N/A ASN 223.A ND2 SER 226.A OG no hydrogen 2.510 N/A SER 226.A OG ASN 223.A O no hydrogen 3.523 N/A GLY 227.A N ASN 223.A O no hydrogen 2.891 N/A LEU 228.A N SER 226.A OG no hydrogen 3.177 N/A VAL 229.A N TYR 245.A O no hydrogen 3.008 N/A LEU 230.A N ILE 221.A O no hydrogen 3.067 N/A ASP 231.A N ILE 243.A O no hydrogen 2.766 N/A VAL 232.A N ASN 252.A O no hydrogen 3.110 N/A ARG 233.A N GLN 241.A O no hydrogen 3.226 N/A ARG 233.A NH1 GLN 241.A OE1 no hydrogen 2.724 N/A ARG 233.A NH2 GLU 196.A OE1 no hydrogen 2.796 N/A SER 235.A N VAL 232.A O no hydrogen 2.989 N/A ASP 236.A N ARG 233.A O no hydrogen 2.986 N/A SER 238.A N ASP 236.A OD1 no hydrogen 2.997 N/A SER 238.A OG ASP 236.A OD1 no hydrogen 2.510 N/A SER 238.A OG ASP 236.A OD2 no hydrogen 2.930 N/A LEU 239.A N ASP 236.A O no hydrogen 3.019 N/A LYS 240.A N PRO 237.A O no hydrogen 3.065 N/A ILE 243.A N ASP 231.A O no hydrogen 2.656 N/A LEU 244.A N THR 197.A O no hydrogen 3.164 N/A TYR 245.A N VAL 229.A O no hydrogen 3.228 N/A HIS 248.A N GLN 253.A OE1 no hydrogen 2.723 N/A GLY 249.A N GLN 253.A OE1 no hydrogen 2.727 N/A ASP 250.A N HIS 248.A ND1 no hydrogen 3.013 N/A ASN 252.A ND2 VAL 232.A O no hydrogen 3.245 N/A GLN 253.A N ASP 250.A O no hydrogen 2.962 N/A GLN 253.A NE2 ASP 231.A OD2 no hydrogen 3.079 N/A GLN 253.A NE2 PRO 246.A O no hydrogen 3.004 N/A TRP 255.A N GLY 219.A O no hydrogen 2.520 N/A LEU 256.A N VAL 145.A O no hydrogen 2.935 N/A LEU 258.A N THR 143.A O no hydrogen 2.648 N/A